TPCN00339
![[object Object]](../../static/browser_molecular_png/TPCN00339.png)
| Name | Vallesamine |
| Molecular Formula | C20H24N2O3 |
| Molecular Weight | 340.42 |
| CAS Registry Number | 3368-87-4 |
| SMILES | CC=C1CN2CCC1C(CO)(C(=O)OC)c1[nH]c3ccccc3c1C2 |
| Classify | Monoterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Apocynaceae | Alstonia scholaris | Leaves | 0.000480% | Fitoterapia, 2015, 105, 160-164. | 10.1016/j.fitote.2015.06.019 |
| Apocynaceae | Alstonia scholaris | Leaves | 0.000019% | Fitoterapia, 2018, 124, 73-79. | 10.1016/j.fitote.2017.10.018 |
Properties
| HBA | 5 | HBD | 2 |
| HeavyAtoms | 25 | AlogP | 2.35 |
| TPSA | 65.56 | RotatableBonds | 2 |
| FractionCSP3 | 0.45 | Rings | 5 |
| AromaticRings | 2 | AliphaticRings | 3 |